2-phenyl-3-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]-2-pyrrol-1-yl-propanoic acid

Systemtic Name: 2-phenyl-3-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]-2-pyrrol-1-yl-propanoic acid Openeye Name: 2-phenyl-3-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]-2-pyrrol-1-yl-propanoic acid CAS Name: 3-[2-[[oxo-[4-(2-pyridinyl)phenyl]methyl]amino]ethoxy]-2-phenyl-2-(1-pyrrolyl)propanoic acid IUPAC Name: 2-phenyl-3-[2-[(4-pyridin-2-ylbenzoyl)amino]ethoxy]-2-pyrrol-1-ylpropanoic acid Traditional Name: 2-phenyl-3-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]-2-pyrrol-1-yl-propionic acid Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(COCCNC(=O)C2=CC=C(C=C2)C3=CC=CC=N3)(C(=O)O)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(COCCNC(=O)C2=CC=C(C=C2)C3=CC=CC=N3)(C(=O)O)N4C=CC=C4

InChI

InChI=1S/C27H25N3O4/c31-25(22-13-11-21(12-14-22)24-10-4-5-15-28-24)29-16-19-34-20-27(26(32)33,30-17-6-7-18-30)23-8-2-1-3-9-23/h1-15,17-18H,16,19-20H2,(H,29,31)(H,32,33)